PUBCHEM-ZINC02985944 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 0 0 0 0 0 0999 V2000 -3.3110 1.6340 -1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1710 0.2140 -1.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 -0.3640 -1.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0540 -1.7380 -1.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 -2.3230 -2.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 -1.5400 -3.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 -0.1700 -3.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4870 0.4190 -2.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -2.1810 -4.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -2.5590 -5.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 -3.1820 -6.5530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -3.5980 -7.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 -3.4570 -8.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 -4.2390 -8.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 -4.6000 -9.9590 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -3.6520 -10.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 -3.3020 -11.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3510 -2.3640 -12.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -1.7730 -13.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 -2.1190 -12.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 -3.0520 -11.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2530 -1.4850 -13.0490 N 0 3 0 0 0 0 0 0 0 0 0 0 3.1620 -0.6580 -13.9390 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3470 -1.7890 -12.6090 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5120 -6.1340 -10.1930 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -6.2980 -11.5970 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 -6.9920 -9.3870 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 -6.1840 -9.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2030 -5.8710 -10.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4790 -5.9110 -9.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6660 -6.2630 -8.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5770 -6.5760 -7.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 -6.5410 -8.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 2.1090 -0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 1.9100 -2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0840 1.9650 -0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6440 -2.3490 -1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 -3.3920 -2.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 0.4390 -4.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6350 1.4880 -2.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 -1.4790 -4.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 -3.0780 -3.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 -3.2610 -5.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3630 -1.6620 -6.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9410 -3.2940 -6.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5280 -3.5370 -8.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 -5.1360 -8.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1470 -3.7640 -11.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3200 -2.0920 -12.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -1.0400 -13.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1060 -3.3190 -11.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0570 -5.5960 -11.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3290 -5.6660 -10.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6620 -6.2930 -8.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 -6.8510 -6.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 -6.7900 -7.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 45 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 19 20 2 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 51 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 26 2 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 31 32 2 0 0 0 0 31 54 1 0 0 0 0 32 33 1 0 0 0 0 32 55 1 0 0 0 0 33 56 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END